gw_large_cell_gamma.F File Reference

#include "./base/base_uses.f90"

Go to the source code of this file.

Modules
module	gw_large_cell_gamma
	Routines from paper [Graml2024].

Functions/Subroutines
subroutine, public	gw_large_cell_gamma::gw_calc_large_cell_gamma (qs_env, bs_env)
	Perform GW band structure calculation.
subroutine, public	gw_large_cell_gamma::fm_read (fm, bs_env, mat_name, idx)
	...
subroutine, public	gw_large_cell_gamma::write_matrix (matrix, matrix_index, matrix_name, fm, qs_env)
	...
subroutine, public	gw_large_cell_gamma::fm_write (fm, matrix_index, matrix_name, qs_env)
	...
subroutine, public	gw_large_cell_gamma::g_occ_vir (bs_env, tau, fm_g_gamma, ispin, occ, vir)
	...
subroutine, public	gw_large_cell_gamma::compute_3c_integrals (qs_env, bs_env, t_3c, atoms_ao_1, atoms_ao_2, atoms_ri)
	...
subroutine, public	gw_large_cell_gamma::get_w_mic (bs_env, qs_env, mat_chi_gamma_tau, fm_w_mic_time)
	...
subroutine, public	gw_large_cell_gamma::compute_fm_chi_gamma_freq (bs_env, fm_chi_gamma_freq, j_w, mat_chi_gamma_tau)
	...
subroutine, public	gw_large_cell_gamma::create_fm_w_mic_time (bs_env, fm_w_mic_time)
	...
subroutine, public	gw_large_cell_gamma::fourier_transform_w_to_t (bs_env, fm_w_mic_time, fm_w_mic_freq_j, j_w)
	...
subroutine, public	gw_large_cell_gamma::multiply_fm_w_mic_time_with_minv_gamma (bs_env, qs_env, fm_w_mic_time)
	...
subroutine, public	gw_large_cell_gamma::fill_fm_sigma_c_gamma_time (fm_sigma_c_gamma_time, bs_env, mat_sigma_pos_tau, mat_sigma_neg_tau)
	...
subroutine, public	gw_large_cell_gamma::delete_unnecessary_files (bs_env)
	...
subroutine, public	gw_large_cell_gamma::compute_qp_energies (bs_env, qs_env, fm_sigma_x_gamma, fm_sigma_c_gamma_time)
	...